In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2004 | 33 | No |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.96 | 8.82 | -61.1 | 0 | 9 | -1 | 122 | 467.479 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 0.63 | -20.89 | 0 | 9 | 0 | 116 | 468.487 | 7 | ↓ |